Secnidazole

C7H11N3O3CAS 3366-95-8185.18 g/mol

NN+OO−NHO
AlcoholNitro

Properties

Molecular formula
C7H11N3O3
Molar mass
185.18 g/mol
Exact mass
185.0800 Da
Melting point
76 °C
logP
0.48Crippen estimate
Polar surface area
81.2 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

Hazards

Warning
Irritant (GHS07)

Aggregated from 9 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P317, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
3366-95-8
SMILES
Cc1ncc([N+](=O)[O-])n1CC(C)O
InChIKey
KPQZUUQMTUIKBP-UHFFFAOYSA-N
InChI
InChI=1S/C7H11N3O3/c1-5(11)4-9-6(2)8-3-7(9)10(12)13/h3,5,11H,4H2,1-2H3

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Type any one amount. The others follow from the molar mass.

Names and synonyms

13 names · show all
  • 1H-Imidazole-1-ethanol, α,2-dimethyl-5-nitro-
  • Imidazole-1-ethanol, α,2-dimethyl-5-nitro-
  • α,2-Dimethyl-5-nitro-1H-imidazole-1-ethanol
  • RP 14539
  • Flagentyl
  • PM 185184
  • 1-(2-Methyl-5-nitroimidazol-1-yl)-2-propanol
  • Secnol
  • Sabima
  • SYM 1219
  • Deprozol
  • Solosec
  • 1-(2-Methyl-5-nitro-1H-imidazol-1-yl)propan-2-ol

Work with Secnidazole

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Same formula

Elsewhere